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Details

Stereochemistry RACEMIC
Molecular Formula C18H22N2OS.ClH
Molecular Weight 350.906
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Vortioxetine sulfoxide hydrochloride

SMILES

Cl.CC1=CC=C([S+]([O-])C2=C(C=CC=C2)N3CCNCC3)C(C)=C1

InChI

InChIKey=KJTWUCLPAYBTOA-UHFFFAOYSA-N
InChI=1S/C18H22N2OS.ClH/c1-14-7-8-17(15(2)13-14)22(21)18-6-4-3-5-16(18)20-11-9-19-10-12-20;/h3-8,13,19H,9-12H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H22N2OS
Molecular Weight 314.445
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:21:28 GMT 2025
Edited
by admin
on Wed Apr 02 19:21:28 GMT 2025
Record UNII
TWY4E7P269
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[2-(2,4-Dimethylphenyl)sulfinylphenyl]piperazine hydrochloride
Preferred Name English
Vortioxetine sulfoxide hydrochloride
Common Name English
Piperazine, 1-[2-[(2,4-dimethylphenyl)sulfinyl]phenyl]-, hydrochloride (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
TWY4E7P269
Created by admin on Wed Apr 02 19:21:28 GMT 2025 , Edited by admin on Wed Apr 02 19:21:28 GMT 2025
PRIMARY
CAS
2236051-10-6
Created by admin on Wed Apr 02 19:21:28 GMT 2025 , Edited by admin on Wed Apr 02 19:21:28 GMT 2025
PRIMARY
PUBCHEM
141515277
Created by admin on Wed Apr 02 19:21:28 GMT 2025 , Edited by admin on Wed Apr 02 19:21:28 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE